SCHEMBL10112744

SCHEMBL10112744

[C-]#[N+]c1cc(F)c(F)c(N2CCC3(CC2)CCN([C@H]2CC[C@@H](O)CC2)C3=O)c1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.35
HSD11B1 P28845 1/20 0.33
HRH3 Q9Y5N1 4/20 0.30
SCN9A Q15858 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10112730 0.87 HSD11B1 (0.38) FFAR4HSD11B1HRH3SCN9A
SCHEMBL4719446 0.80 FFAR4 (0.35) FFAR4HSD11B1HRH3SCN9A
SCHEMBL5631276 0.80 FFAR4 (0.35) FFAR4HSD11B1HRH3SCN9A
SCHEMBL5630400 0.74 HSD11B1 (0.39) FFAR4HSD11B1HRH3SCN9A
SCHEMBL4718410 0.74 HSD11B1 (0.39) FFAR4HSD11B1HRH3SCN9A
SCHEMBL10112648 0.74 HSD11B1 (0.35) FFAR4HSD11B1
SCHEMBL10112533 0.74 HSD11B1 (0.35) FFAR4HSD11B1
SCHEMBL5630597 0.72 HSD11B1 (0.37) HSD11B1SCN9A
SCHEMBL5631223 0.72 HSD11B1 (0.37) HSD11B1SCN9A
SCHEMBL5630592 0.72 HSD11B1 (0.37) HSD11B1SCN9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8193207-B2 Lactam compounds and methods of using the same INCYTE CORPORATION (US) 2012-06-05 US disclosed
US-20070129345-A1 Lactam compounds and methods of using the same INCYTE CORPORATION 2007-06-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070129345-A1 Lactam compounds and methods of using the same HSD11B1, HSD17B11, HSD17B1 FFAR4 4151/4885HSD11B1 1/4885HRH3 2940/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.